Geometry & MOs

Info

ID:	74206
PubChem CID:	48421584
Reduced:	N3O5C16H21 (1)
Stoich.:	A3B5C16D21 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-115.64
Dipole, Da:	3.13
IP(EA), eV:	-9.49(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[cyclopropylmethyl-[(3-methylphenyl)carbamoyl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCN(CC1CC1)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

DOS

IR

Vibrations