Geometry & MOs

Info

ID:	391353
PubChem CID:	135004459
Reduced:	N3O5H17C24 (1)
Stoich.:	A3B5C17D24 (1)
Weight, g/mol:	303.201841
ΔH_f, kcal/mol:	44.56
Dipole, Da:	3.49
IP(EA), eV:	-9.11(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methoxyphenyl)methyl]-4,4-dimethyl-1-trimethylsilylpent-1-yn-3-amine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C(NC(O3)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC(=CC=C5)[N+](=O)[O-]

DOS

IR

Vibrations