Geometry & MOs

Info

ID:	439026
PubChem CID:	135228789
Reduced:	N3O4C26H31 (1)
Stoich.:	A3B4C26D31 (1)
Weight, g/mol:	281.21435
ΔH_f, kcal/mol:	-112.03
Dipole, Da:	5.07
IP(EA), eV:	-9.04(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-methyl-4-(3-methylidenecyclopropen-1-yl)-5-(2,3,3-trimethylbutyl)phenyl]ethanimine

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2C(CC3=CC(=C(C=C3C2=CC1=O)OC)C4=CC(=NN4C)C)C(C)(C)C

DOS

IR

Vibrations